PUBCHEM-ZINC02864593 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.4100 0.8220 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.5650 2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -1.2320 1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -0.5220 1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 0.8920 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 1.5450 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 1.7170 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.0560 0.9550 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1030 -1.1540 1.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -2.5050 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -3.4010 1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 -2.9240 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -2.0300 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -2.5030 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 -3.8670 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -4.7610 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -4.3010 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 -6.5060 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 -7.1910 -0.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 -6.7260 -0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 -6.8070 1.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 -6.0560 2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 -5.8680 3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 -5.1900 4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 -4.6970 4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4970 -4.9040 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 -5.5910 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9130 -4.0010 5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4850 -3.9530 6.7080 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3020 1.3420 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -1.1330 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -2.3140 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 2.6310 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -0.4470 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -0.9590 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 -1.7950 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 -4.2100 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -5.0140 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -7.1980 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -6.2460 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 -5.0560 5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4830 -4.5420 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1420 -5.7620 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 2.9780 1.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0300 -3.5400 5.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 44 2 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 45 2 0 0 0 0 M CHG 1 8 -1 M CHG 1 29 -1 M END